N-[4-(4-chloranylphenoxy)phenyl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine

Systemtic Name: N-[4-(4-chloranylphenoxy)phenyl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine Openeye Name: N-[4-(4-chlorophenoxy)phenyl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine CAS Name: N-[4-(4-chlorophenoxy)phenyl]-6-methyl-2-(4-nitro-1-pyrazolyl)-4-pyrimidinamine IUPAC Name: N-[4-(4-chlorophenoxy)phenyl]-6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-amine Traditional Name: [4-(4-chlorophenoxy)phenyl]-[6-methyl-2-(4-nitropyrazol-1-yl)pyrimidin-4-yl]amine Formula: C20H15ClN6O3 MolecularWeight: 422.8245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=C(C=N2)[N+](=O)[O-])NC3=CC=C(C=C3)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=C(C=N2)[N+](=O)[O-])NC3=CC=C(C=C3)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN6O3/c1-13-10-19(25-20(23-13)26-12-16(11-22-26)27(28)29)24-15-4-8-18(9-5-15)30-17-6-2-14(21)3-7-17/h2-12H,1H3,(H,23,24,25)